Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cqo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A ND2 VAL 143.A O no hydrogen 3.356 N/A LEU 8.A N ASN 5.A O no hydrogen 3.294 N/A ARG 9.A N VAL 6.A O no hydrogen 3.064 N/A ARG 9.A NH1 TYR 61.A OH no hydrogen 3.039 N/A ARG 9.A NH1 ASP 293.A OD2 no hydrogen 2.767 N/A ARG 9.A NH2 ASP 293.A OD2 no hydrogen 3.380 N/A GLY 10.A N ALA 7.A O no hydrogen 3.062 N/A LYS 11.A N ASP 56.A O no hydrogen 3.076 N/A THR 13.A N ARG 54.A O no hydrogen 2.901 N/A GLN 14.A NE2 GLY 23.A O no hydrogen 2.981 N/A GLN 14.A NE2 HIS 44.A O no hydrogen 3.543 N/A SER 15.A N TRP 52.A O no hydrogen 2.877 N/A SER 15.A OG TRP 52.A O no hydrogen 3.417 N/A ARG 17.A NH2 HIS 20.A O no hydrogen 3.040 N/A TYR 18.A N HIS 44.A O no hydrogen 3.002 N/A THR 21.A OG1 HIS 22.A ND1 no hydrogen 2.833 N/A HIS 22.A N HIS 20.A ND1 no hydrogen 3.037 N/A HIS 22.A ND1 THR 21.A OG1 no hydrogen 2.833 N/A ASN 27.A N ALA 24.A O no hydrogen 3.080 N/A ASN 27.A ND2 CYS 42.A O no hydrogen 2.802 N/A ALA 28.A N ALA 25.A O no hydrogen 3.345 N/A ILE 29.A N TYR 26.A O no hydrogen 3.054 N/A GLY 31.A N GLU 140.A OE2 no hydrogen 2.946 N/A ASN 32.A N ASP 30.A OD1 no hydrogen 3.170 N/A ARG 33.A NE GLU 142.A OE2 no hydrogen 2.610 N/A ARG 33.A NH2 GLU 142.A OE1 no hydrogen 3.272 N/A ARG 33.A NH2 GLU 142.A OE2 no hydrogen 3.032 N/A ASN 34.A N ASN 32.A OD1 no hydrogen 2.810 N/A PHE 37.A N ASP 73.A OD2 no hydrogen 3.139 N/A GLU 38.A N ASP 36.A OD1 no hydrogen 3.163 N/A ALA 39.A N ASP 36.A O no hydrogen 2.795 N/A GLY 40.A N PHE 37.A O no hydrogen 3.183 N/A SER 41.A OG ASP 30.A OD1 no hydrogen 3.062 N/A SER 41.A OG ASP 30.A OD2 no hydrogen 2.916 N/A SER 41.A OG ASN 32.A O no hydrogen 3.079 N/A CYS 42.A SG ASN 34.A O no hydrogen 3.221 N/A THR 43.A N LEU 138.A O no hydrogen 2.779 N/A THR 43.A OG1 LEU 138.A O no hydrogen 3.186 N/A HIS 44.A N GLY 23.A O no hydrogen 3.183 N/A HIS 44.A ND1 THR 45.A O no hydrogen 2.816 N/A THR 45.A N LEU 136.A O no hydrogen 3.012 N/A THR 45.A OG1 VAL 46.A O no hydrogen 3.052 N/A VAL 46.A N ALA 16.A O no hydrogen 2.993 N/A GLN 48.A N LYS 134.A O no hydrogen 2.798 N/A ASN 50.A N GLY 131.A O no hydrogen 2.982 N/A TRP 52.A N SER 15.A OG no hydrogen 3.137 N/A TRP 53.A N VAL 127.A O no hydrogen 2.934 N/A TRP 53.A NE1 ALA 25.A O no hydrogen 2.984 N/A ARG 54.A N THR 13.A O no hydrogen 2.819 N/A ARG 54.A NH1 ASN 93.A O no hydrogen 3.007 N/A ARG 54.A NH1 ASN 93.A OD1 no hydrogen 3.340 N/A VAL 55.A N VAL 125.A O no hydrogen 3.102 N/A ASP 56.A N LYS 11.A O no hydrogen 2.850 N/A LEU 57.A N ARG 123.A O no hydrogen 2.897 N/A LEU 58.A N ASP 56.A OD1 no hydrogen 2.756 N/A TYR 61.A N GLY 122.A O no hydrogen 3.099 N/A ILE 62.A N TYR 146.A O no hydrogen 2.793 N/A VAL 63.A N VAL 120.A O no hydrogen 2.839 N/A THR 64.A N HIS 144.A O no hydrogen 2.850 N/A THR 64.A OG1 HIS 144.A O no hydrogen 3.043 N/A ILE 66.A N ILE 114.A O no hydrogen 2.975 N/A THR 67.A N GLU 142.A O no hydrogen 2.847 N/A THR 67.A OG1 THR 113.A OG1 no hydrogen 2.946 N/A ILE 68.A N HIS 112.A O no hydrogen 2.807 N/A THR 69.A N GLU 140.A O no hydrogen 3.031 N/A THR 69.A OG1 SER 111.A OG no hydrogen 2.765 N/A ASN 70.A N ILE 110.A O no hydrogen 3.095 N/A ASN 70.A ND2 PRO 76.A O no hydrogen 2.733 N/A ASN 70.A ND2 ILE 106.A O no hydrogen 2.775 N/A ARG 71.A N ASN 70.A OD1 no hydrogen 2.754 N/A ARG 71.A NE ASP 73.A OD1 no hydrogen 3.431 N/A ARG 71.A NE ASP 73.A OD2 no hydrogen 2.846 N/A ARG 71.A NH2 ASP 73.A OD1 no hydrogen 2.979 N/A GLY 72.A N SER 35.A O no hydrogen 2.595 N/A GLU 77.A N GLU 77.A OE2 no hydrogen 2.656 N/A ARG 78.A N CYS 75.A O no hydrogen 3.338 N/A LEU 79.A N PRO 76.A O no hydrogen 3.454 N/A ASN 80.A N GLU 77.A O no hydrogen 3.099 N/A GLY 81.A N ILE 103.A O no hydrogen 2.949 N/A GLY 81.A N SER 104.A O no hydrogen 3.358 N/A VAL 82.A N LEU 79.A O no hydrogen 3.357 N/A GLU 83.A N LEU 128.A O no hydrogen 2.801 N/A ILE 84.A N GLY 101.A O no hydrogen 2.893 N/A HIS 85.A N THR 126.A O no hydrogen 2.824 N/A HIS 85.A ND1 ASN 97.A O no hydrogen 2.911 N/A HIS 85.A NE2 GLU 83.A OE1 no hydrogen 2.945 N/A ILE 86.A N PRO 98.A O no hydrogen 3.179 N/A GLY 87.A N TYR 124.A O no hydrogen 3.171 N/A ASN 88.A ND2 GLU 121.A OE1 no hydrogen 3.427 N/A SER 89.A N ASN 97.A OD1 no hydrogen 3.000 N/A GLN 91.A N SER 89.A OG no hydrogen 3.210 N/A GLY 94.A N GLN 91.A O no hydrogen 2.965 N/A VAL 95.A N GLU 92.A O no hydrogen 2.847 N/A ASN 97.A N GLY 94.A O no hydrogen 3.011 N/A ASN 97.A ND2 SER 89.A O no hydrogen 2.926 N/A ASN 97.A ND2 GLY 94.A O no hydrogen 3.013 N/A ARG 99.A NH1 GLU 83.A OE2 no hydrogen 3.002 N/A VAL 100.A N ILE 84.A O no hydrogen 2.797 N/A ILE 103.A N VAL 82.A O no hydrogen 3.004 N/A HIS 105.A ND1 ASN 80.A OD1 no hydrogen 2.843 N/A GLY 109.A N ARG 71.A O no hydrogen 3.003 N/A ILE 110.A N PRO 107.A O no hydrogen 3.202 N/A SER 111.A OG THR 69.A OG1 no hydrogen 2.765 N/A HIS 112.A N ILE 68.A O no hydrogen 2.782 N/A THR 113.A OG1 THR 67.A OG1 no hydrogen 2.946 N/A ILE 114.A N ILE 66.A O no hydrogen 2.850 N/A PHE 116.A N THR 64.A O no hydrogen 2.839 N/A THR 117.A N GLU 118.A OE2 no hydrogen 3.146 N/A THR 117.A OG1 GLU 118.A OE2 no hydrogen 3.405 N/A GLY 122.A N TYR 61.A O no hydrogen 3.033 N/A ARG 123.A N GLY 87.A O no hydrogen 3.007 N/A ARG 123.A NE ASP 56.A OD1 no hydrogen 2.754 N/A ARG 123.A NE ASP 56.A OD2 no hydrogen 3.375 N/A ARG 123.A NH2 ASP 56.A OD2 no hydrogen 2.901 N/A TYR 124.A N GLY 87.A O no hydrogen 3.058 N/A VAL 125.A N VAL 55.A O no hydrogen 3.242 N/A THR 126.A N HIS 85.A O no hydrogen 2.795 N/A THR 126.A OG1 ASN 93.A O no hydrogen 2.975 N/A VAL 127.A N TRP 53.A O no hydrogen 2.706 N/A LEU 128.A N GLU 83.A O no hydrogen 2.948 N/A LEU 129.A N PRO 51.A O no hydrogen 2.999 N/A GLY 131.A N ASN 50.A OD1 no hydrogen 2.849 N/A LYS 134.A N GLN 48.A O no hydrogen 2.745 N/A LEU 136.A N THR 45.A OG1 no hydrogen 2.889 N/A THR 137.A OG1 THR 43.A O no hydrogen 3.141 N/A LEU 138.A N THR 43.A OG1 no hydrogen 2.777 N/A CYS 139.A N THR 69.A O no hydrogen 3.042 N/A CYS 139.A SG ASN 34.A O no hydrogen 3.684 N/A VAL 141.A N ALA 28.A O no hydrogen 2.842 N/A GLU 142.A N THR 67.A O no hydrogen 2.864 N/A HIS 144.A N SER 65.A O no hydrogen 2.921 N/A TYR 146.A N ILE 62.A O no hydrogen 3.102 N/A ARG 147.A NH1 ASP 293.A OD2 no hydrogen 2.896 N/A ARG 147.A NH2 GLU 59.A OE1 no hydrogen 2.659 N/A ALA 148.A N PRO 60.A O no hydrogen 2.899 N/A ASN 153.A ND2 VAL 287.A O no hydrogen 3.377 N/A LEU 154.A N VAL 287.A O no hydrogen 2.747 N/A LEU 156.A N ASN 153.A O no hydrogen 3.362 N/A LYS 157.A N LEU 154.A O no hydrogen 3.089 N/A GLY 158.A N ALA 155.A O no hydrogen 3.206 N/A LYS 159.A N ASP 202.A O no hydrogen 3.185 N/A THR 161.A N ARG 200.A O no hydrogen 2.952 N/A GLN 162.A NE2 GLY 169.A O no hydrogen 2.899 N/A GLN 162.A NE2 HIS 190.A O no hydrogen 3.494 N/A SER 163.A N TRP 198.A O no hydrogen 2.885 N/A PHE 166.A N HIS 190.A O no hydrogen 2.724 N/A GLY 169.A N PHE 166.A O no hydrogen 3.138 N/A ILE 170.A N SER 168.A O no hydrogen 2.945 N/A ASN 173.A N ILE 170.A O no hydrogen 2.957 N/A ASN 173.A ND2 SER 168.A O no hydrogen 3.679 N/A ASN 173.A ND2 CYS 188.A O no hydrogen 2.904 N/A ALA 174.A N ALA 171.A O no hydrogen 3.248 N/A ILE 175.A N TYR 172.A O no hydrogen 3.061 N/A GLY 177.A N GLU 284.A OE2 no hydrogen 2.938 N/A ASN 178.A N ASP 176.A OD1 no hydrogen 3.204 N/A GLN 179.A NE2 GLU 286.A OE2 no hydrogen 2.645 N/A ALA 180.A N ASN 178.A OD1 no hydrogen 2.966 N/A ASN 182.A ND2 ASP 218.A OD2 no hydrogen 2.735 N/A GLU 184.A N ASN 182.A OD1 no hydrogen 2.941 N/A MET 185.A N ASN 182.A O no hydrogen 2.783 N/A ALA 186.A N TRP 183.A O no hydrogen 3.136 N/A SER 187.A OG ASP 176.A OD2 no hydrogen 2.486 N/A SER 187.A OG ASN 178.A O no hydrogen 3.165 N/A CYS 188.A SG ALA 180.A O no hydrogen 3.670 N/A THR 189.A N LEU 282.A O no hydrogen 2.690 N/A THR 189.A OG1 LEU 282.A O no hydrogen 3.214 N/A HIS 190.A N GLY 169.A O no hydrogen 2.745 N/A HIS 190.A ND1 THR 191.A O no hydrogen 2.805 N/A THR 191.A N LEU 280.A O no hydrogen 3.043 N/A THR 191.A OG1 LYS 192.A O no hydrogen 3.388 N/A LYS 192.A N SER 164.A OG no hydrogen 2.838 N/A THR 194.A N GLU 278.A O no hydrogen 3.285 N/A ASP 196.A N ARG 276.A O no hydrogen 3.007 N/A TRP 198.A N SER 163.A OG no hydrogen 3.190 N/A TRP 199.A N ILE 271.A O no hydrogen 2.947 N/A TRP 199.A NE1 ALA 171.A O no hydrogen 2.986 N/A ARG 200.A N THR 161.A O no hydrogen 2.773 N/A ARG 200.A NH1 ASN 238.A O no hydrogen 3.018 N/A MET 201.A N VAL 269.A O no hydrogen 2.995 N/A ASP 202.A N LYS 159.A O no hydrogen 2.857 N/A LEU 203.A N ARG 267.A O no hydrogen 2.897 N/A SER 204.A N ASP 202.A OD1 no hydrogen 2.803 N/A GLN 205.A N LEU 203.A O no hydrogen 2.785 N/A GLN 205.A NE2 VAL 291.A O no hydrogen 3.646 N/A THR 206.A OG1 ASP 233.A OD1 no hydrogen 3.179 N/A HIS 207.A N GLY 266.A O no hydrogen 3.118 N/A ARG 208.A N SER 290.A O no hydrogen 3.162 N/A ARG 208.A NE ASP 265.A OD1 no hydrogen 2.766 N/A ARG 208.A NH1 TYR 3.A OH no hydrogen 2.843 N/A ARG 208.A NH1 TYR 146.A OH no hydrogen 3.560 N/A ARG 208.A NH2 TYR 3.A OH no hydrogen 2.982 N/A ARG 208.A NH2 ASP 265.A OD1 no hydrogen 3.356 N/A ARG 208.A NH2 ASP 265.A OD2 no hydrogen 3.004 N/A VAL 209.A N MET 264.A O no hydrogen 2.918 N/A PHE 210.A N TYR 288.A O no hydrogen 2.768 N/A SER 211.A N TYR 288.A O no hydrogen 3.268 N/A VAL 212.A N PHE 259.A O no hydrogen 2.938 N/A LYS 213.A N GLU 286.A O no hydrogen 2.835 N/A LYS 213.A NZ GLU 286.A OE1 no hydrogen 3.316 N/A VAL 214.A N THR 257.A O no hydrogen 2.792 N/A THR 215.A N GLU 284.A O no hydrogen 2.997 N/A THR 215.A OG1 SER 256.A OG no hydrogen 2.864 N/A ASN 216.A N ALA 255.A O no hydrogen 3.029 N/A ASN 216.A ND2 GLU 221.A O no hydrogen 2.689 N/A ASN 216.A ND2 ILE 251.A O no hydrogen 2.755 N/A ARG 217.A N ASN 216.A OD1 no hydrogen 2.769 N/A ASP 218.A N ASN 181.A O no hydrogen 2.953 N/A SER 219.A OG ASP 218.A OD1 no hydrogen 2.693 N/A ARG 223.A N PHE 220.A O no hydrogen 3.242 N/A ASN 225.A N LYS 222.A O no hydrogen 3.274 N/A GLY 226.A N ILE 248.A O no hydrogen 2.608 N/A ALA 227.A N ILE 224.A O no hydrogen 2.930 N/A GLU 228.A N VAL 272.A O no hydrogen 2.779 N/A ILE 229.A N ALA 246.A O no hydrogen 3.026 N/A ARG 230.A N ASN 270.A O no hydrogen 2.785 N/A ARG 230.A NE GLU 228.A OE1 no hydrogen 3.270 N/A ARG 230.A NH1 ASN 242.A O no hydrogen 2.797 N/A ARG 230.A NH2 GLU 228.A OE1 no hydrogen 3.040 N/A ILE 231.A N PRO 243.A O no hydrogen 2.806 N/A GLY 232.A N TYR 268.A O no hydrogen 3.268 N/A SER 234.A N ASN 242.A OD1 no hydrogen 3.288 N/A ASP 236.A N SER 234.A OG no hydrogen 3.083 N/A GLY 239.A N ASP 236.A O no hydrogen 3.132 N/A ASN 240.A N ASN 237.A O no hydrogen 3.085 N/A ASN 240.A ND2 ASN 237.A O no hydrogen 3.125 N/A ASN 242.A N GLY 239.A O no hydrogen 3.279 N/A ASN 242.A ND2 SER 234.A O no hydrogen 2.970 N/A ARG 244.A NE GLU 228.A OE2 no hydrogen 3.390 N/A CYS 245.A N ILE 229.A O no hydrogen 2.592 N/A ALA 246.A N ILE 229.A O no hydrogen 3.441 N/A ILE 248.A N ALA 227.A O no hydrogen 2.624 N/A GLY 254.A N ARG 217.A O no hydrogen 3.211 N/A ALA 255.A N PRO 252.A O no hydrogen 2.792 N/A SER 256.A OG THR 215.A OG1 no hydrogen 2.864 N/A THR 257.A N VAL 214.A O no hydrogen 2.922 N/A PHE 259.A N VAL 212.A O no hydrogen 2.788 N/A GLN 260.A NE2 GLU 258.A OE2 no hydrogen 3.165 N/A CYS 261.A N PHE 210.A O no hydrogen 2.932 N/A MET 264.A N VAL 209.A O no hydrogen 3.223 N/A GLY 266.A N HIS 207.A O no hydrogen 2.927 N/A ARG 267.A N GLY 232.A O no hydrogen 2.961 N/A ARG 267.A NH1 ASP 202.A OD1 no hydrogen 2.852 N/A ARG 267.A NH1 ASP 202.A OD2 no hydrogen 2.724 N/A TYR 268.A N GLY 232.A O no hydrogen 3.017 N/A VAL 269.A N MET 201.A O no hydrogen 3.163 N/A ASN 270.A N ARG 230.A O no hydrogen 2.782 N/A ILE 271.A N TRP 199.A O no hydrogen 2.915 N/A VAL 272.A N GLU 228.A O no hydrogen 3.091 N/A ILE 273.A N PRO 197.A O no hydrogen 3.200 N/A GLU 278.A N THR 194.A O no hydrogen 3.101 N/A TYR 279.A N GLU 278.A OE2 no hydrogen 2.707 N/A LEU 280.A N THR 191.A OG1 no hydrogen 2.745 N/A THR 281.A OG1 THR 189.A O no hydrogen 3.484 N/A LEU 282.A N THR 189.A OG1 no hydrogen 3.017 N/A CYS 283.A N THR 215.A O no hydrogen 3.185 N/A CYS 283.A SG ASN 181.A O no hydrogen 4.030 N/A VAL 285.A N ALA 174.A O no hydrogen 2.710 N/A GLU 286.A N LYS 213.A O no hydrogen 2.826 N/A TYR 288.A N SER 211.A O no hydrogen 2.920 N/A TYR 288.A OH GLU 286.A OE1 no hydrogen 2.382 N/A SER 290.A N ARG 208.A O no hydrogen 2.987 N/A SER 290.A OG ARG 147.A O no hydrogen 2.192 N/A